[4-[(E)-3-[(2R)-octan-2-yl]oxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-decoxybenzoate

Systemtic Name: [4-[(E)-3-[(2R)-octan-2-yl]oxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-decoxybenzoate Openeye Name: [4-[(E)-3-[(1R)-1-methylheptoxy]-3-oxo-prop-1-enyl]phenyl] 4-decoxybenzoate CAS Name: 4-decoxybenzoic acid [4-[(E)-3-[(2R)-octan-2-yl]oxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-[(2R)-octan-2-yl]oxy-3-oxoprop-1-enyl]phenyl] 4-decoxybenzoate Traditional Name: 4-decoxybenzoic acid [4-[(E)-3-keto-3-[(1R)-1-methylheptoxy]prop-1-enyl]phenyl] ester Formula: C34H48O5 MolecularWeight: 536.74192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=CC(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C/C(=O)O[C@H](C)CCCCCC

InChI

InChI=1S/C34H48O5/c1-4-6-8-10-11-12-13-15-27-37-31-24-20-30(21-25-31)34(36)39-32-22-17-29(18-23-32)19-26-33(35)38-28(3)16-14-9-7-5-2/h17-26,28H,4-16,27H2,1-3H3/b26-19+/t28-/m1/s1